Chemical Properties of Diethyl glutaconate (CAS 2049-67-4)

Diethyl glutaconate

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InChI
InChI=1S/C9H14O4/c1-3-12-8(10)6-5-7-9(11)13-4-2/h5-6H,3-4,7H2,1-2H3/b6-5+
InChI Key
JHCKGVJZNIWNJK-AATRIKPKSA-N
Formula
C9H14O4
SMILES
CCOC(=O)C=CCC(=O)OCC
Molecular Weight1
186.21
CAS
2049-67-4
Other Names
  • 2-Pentenedioic acid, diethyl ester
  • Diethyl 2-pentenedioate
  • Glutaconic acid, diethyl ester
  • diethyl pent-2-enedioate
Sources

Physical Properties

Property Value Unit Source
Δf -362.72 kJ/mol Joback Calculated Property
Δfgas -601.47 kJ/mol Joback Calculated Property
Δfus 24.84 kJ/mol Joback Calculated Property
Δvap 53.90 kJ/mol Joback Calculated Property
logPoct/wat 1.06 Crippen Calculated Property
Pc 2662.52 kPa Joback Calculated Property
Tboil 510.20 K NIST
Tc 751.36 K Joback Calculated Property
Tfus 330.43 K Joback Calculated Property
Vc 0.57 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 348.78 J/mol×K 562.06 Joback Calculated Property
η 0.00 Pa×s 562.06 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH2- 3
>C=O (nonring) 2
=CH- 2
-CH3 2

Similar Compounds

2-Pentenedioic acid, dimethyl ester. (Z)-3-Pentenoic acid ethyl ester. (Z)-2-Pentenoic acid ethyl ester. Ethyl trans-2-pentenoate. 2-Pentenoic acid butyl ester. 2H-Pyran-2,6(3H)-dione. 2-Hexenoic acid, 3-hexenyl ester, (E,Z)-. 3,6-Dihydro-2H-pyran-2-one. 2H-Pyran-2-one, 3,6-dihydro. 3-Hexenoic acid, ethyl ester, (Z)-. 2H-Pyran-2-one, 5,6-dihydro-. 3-Hexenoic acid, ethyl ester. 3-Hexenoic acid, ethyl ester, (E)-. 2-Butenoic acid, 3-hexenyl ester, (E,Z)-. 2-Hexenoic acid, butyl ester, (e)-.

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